N-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: 3-[(2S)-2-methylpiperidino]sulfonyl-N-piperonyl-benzamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O5S/c1-15-5-2-3-10-23(15)29(25,26)18-7-4-6-17(12-18)21(24)22-13-16-8-9-19-20(11-16)28-14-27-19/h4,6-9,11-12,15H,2-3,5,10,13-14H2,1H3,(H,22,24)/t15-/m0/s1